3-(1,3-benzodioxol-5-yl)-N-(1,3-benzothiazol-2-yl)-N-(3-fluoranyl-4-methyl-phenyl)propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-(1,3-benzothiazol-2-yl)-N-(3-fluoranyl-4-methyl-phenyl)propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-(1,3-benzothiazol-2-yl)-N-(3-fluoro-4-methyl-phenyl)propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-(1,3-benzothiazol-2-yl)-N-(3-fluoro-4-methylphenyl)propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-(1,3-benzothiazol-2-yl)-N-(3-fluoro-4-methylphenyl)propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-(1,3-benzothiazol-2-yl)-N-(3-fluoro-4-methyl-phenyl)propionamide Formula: C24H19FN2O3S MolecularWeight: 434.482663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CCC4=CC5=C(C=C4)OCO5)F

Isomeric SMILES

CC1=C(C=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CCC4=CC5=C(C=C4)OCO5)F

InChI

InChI=1S/C24H19FN2O3S/c1-15-6-9-17(13-18(15)25)27(24-26-19-4-2-3-5-22(19)31-24)23(28)11-8-16-7-10-20-21(12-16)30-14-29-20/h2-7,9-10,12-13H,8,11,14H2,1H3